| Literature DB >> 22907923 |
Nils O B Lüttschwager1, Tobias N Wassermann, Ricardo A Mata, Martin A Suhm.
Abstract
Mother of all folding: cold isolated linear alkanes C(n)H(2n+2) prefer an extended all-trans conformation before cohesive forces between the chain ends induce a folded hairpin structure for longer chains. It is shown by Raman spectroscopy at 100-150 K that the folded structure becomes more stable beyond n(C) = 17 or 18 carbon atoms. High-level quantum-chemical calculations yield n(C) = 17 ± 1 as the critical chain length.Entities:
Year: 2012 PMID: 22907923 DOI: 10.1002/anie.201202894
Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN: 1433-7851 Impact factor: 15.336